Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 5/20 | 0.61 |
| ▸ | CASP1 | P29466 | 1/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.45 |
| ▸ | P2RY14 | Q15391 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.44 |
| ▸ | MARS1 | P56192 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | IGFBP3 | P17936 | 1/20 | 0.42 |
| ▸ | TTR | P02766 | 1/20 | 0.42 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL3408828 | 0.99 | KMO (0.62) | KMOCASP1ADORA3P2RY14KDM4E | |
| Potassium SCHEMBL29961608 | 0.97 | KMO (0.61) | KMOCASP1ADORA3P2RY14KDM4E | |
| Dimethylformamide SCHEMBL27799820 | 0.89 | KMO (0.52) | KMOCASP1ADORA3P2RY14KDM4E | |
| SCHEMBL29062398 | 0.85 | KMO (0.68) | KMOADORA3KDM4EALDH1A1MCL1 | |
| Potassium Ion SCHEMBL29020190 | 0.84 | KMO (0.46) | KMOCASP1ADORA3P2RY14ALDH1A1 | |
| SCHEMBL29020155 | 0.83 | KMO (0.69) | KMOKDM4EALDH1A1MCL1MAPT | |
| SCHEMBL18002850 | 0.82 | MAPT (0.48) | KMOCASP1ADORA3KDM4EALDH1A1 | |
| SCHEMBL29020178 | 0.82 | DHODH (0.57) | KMOADORA3MCL1MARS1 | |
| SCHEMBL3404202 | 0.82 | ADORA3 (0.45) | KMOCASP1ADORA3KDM4EALDH1A1 | |
| SCHEMBL3560093 | 0.82 | MCL1 (0.50) | ADORA3P2RY14KDM4EALDH1A1MCL1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115093400-B | AhR inhibitor, application and preparation method thereof | 北京华森英诺生物科技有限公司 | 2023-09-05 | — | — | CN | disclosed |
| CN-115093400-A | AhR inhibitor and application and preparation method thereof | 重庆华森制药股份有限公司 | 2022-09-23 | — | — | CN | disclosed |